| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(c1sc(C(=O)NO)cc1)N4Cc3ncc(c2ccccc2)n3CC4 |
| SMILES_CANONICAL | CACTVS | 3.341 | ONC(=O)c1sc(cc1)C(=O)N2CCn3c(C2)ncc3c4ccccc4 |
| SMILES | CACTVS | 3.341 | ONC(=O)c1sc(cc1)C(=O)N2CCn3c(C2)ncc3c4ccccc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2cnc3n2CCN(C3)C(=O)c4ccc(s4)C(=O)NO |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2cnc3n2CCN(C3)C(=O)c4ccc(s4)C(=O)NO |
| InChI | InChI | 1.03 | InChI=1S/C18H16N4O3S/c23-17(20-25)14-6-7-15(26-14)18(24)21-8-9-22-13(10-19-16(22)11-21)12-4-2-1-3-5-12/h1-7,10,25H,8-9,11H2,(H,20,23) |
| InChIKey | InChI | 1.03 | SMSIXMLQOONOQQ-UHFFFAOYSA-N |
